Log in
Browse 
Membranes
Search
Statistics
Lab
DocumentationIdentifier: MM163131
2D Structure
3D Structure
Source:
| General | |
| Identifier | MM163131 |
| SMILES |
COC=CC(O)C(C)N
|
| InChIKey |
QJAAUFZSWZLZNK-UHFFFAOYSA-N
|
| MW [Da] |
131.18
Automatically obtained from RDkit software. |
| LogP |
-0.15
Automatically obtained from RDkit software. |
| Links | |
|
PubChem |
N/A |
|
DrugBank |
N/A |
|
ChEBI |
N/A |
|
PDB |
N/A |
|
ChEMBL |
N/A |
Similar entries
MM73339
Similarity: 0.8807
Similarity to MM73339
| Tanimoto metric | 0.8807 |
|---|---|
| Cosine metric | 0.9385 |
| Dice metric | 0.9366 |
| MW: | 143.19 |
||||
|---|---|---|---|---|---|
| PI: | 1
Total passive interactions
|
| LogP: | 0.37 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM305720
Similarity: 0.8649
Similarity to MM305720
| Tanimoto metric | 0.8649 |
|---|---|
| Cosine metric | 0.93 |
| Dice metric | 0.9275 |
| MW: | 145.2 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | 0.24 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
MM305801
Similarity: 0.8421
Similarity to MM305801
| Tanimoto metric | 0.8421 |
|---|---|
| Cosine metric | 0.9177 |
| Dice metric | 0.9143 |
| MW: | 145.16 |
||||
|---|---|---|---|---|---|
| PI: | 2
Total passive interactions
|
| LogP: | -0.62 |
||||
|---|---|---|---|---|---|
| AI: | 0
Total active interactions
|
+350 more
